Geometry & MOs

Info

ID:	239163
PubChem CID:	93166074
Reduced:	NO3C19H31 (1)
Stoich.:	AB3C19D31 (1)
Weight, g/mol:	269.14495
ΔH_f, kcal/mol:	-111.9
Dipole, Da:	2.8
IP(EA), eV:	-8.75(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[[(2S)-oxolan-2-yl]methyl-(thiophen-3-ylmethyl)amino]propan-2-ol

Drug info:

PubChemData

Smile

CC(C)CCN(CC1=C(C(=CC=C1)OC)OC)C[C@](C)(C=C)O

DOS

IR

Vibrations